5-[(4-chlorophenyl)methyl]-2,2-dimethyl-5-phenacyl-1,3-dioxane-4,6-dione

Systemtic Name: 5-[(4-chlorophenyl)methyl]-2,2-dimethyl-5-phenacyl-1,3-dioxane-4,6-dione Openeye Name: 5-[(4-chlorophenyl)methyl]-2,2-dimethyl-5-phenacyl-1,3-dioxane-4,6-dione CAS Name: 5-[(4-chlorophenyl)methyl]-2,2-dimethyl-5-phenacyl-1,3-dioxane-4,6-dione IUPAC Name: 5-[(4-chlorophenyl)methyl]-2,2-dimethyl-5-phenacyl-1,3-dioxane-4,6-dione Traditional Name: 5-(4-chlorobenzyl)-2,2-dimethyl-5-phenacyl-1,3-dioxane-4,6-quinone Formula: C21H19ClO5 MolecularWeight: 386.82556

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OC(=O)C(C(=O)O1)(CC2=CC=C(C=C2)Cl)CC(=O)C3=CC=CC=C3)C

Isomeric SMILES

CC1(OC(=O)C(C(=O)O1)(CC2=CC=C(C=C2)Cl)CC(=O)C3=CC=CC=C3)C

InChI

InChI=1S/C21H19ClO5/c1-20(2)26-18(24)21(19(25)27-20,12-14-8-10-16(22)11-9-14)13-17(23)15-6-4-3-5-7-15/h3-11H,12-13H2,1-2H3